Water-resistant Fe–Ca–Ox/TiO2 catalysts for low temperature 1,2-dichlorobenzene oxidation X Ma, J Shen, W Pu, H Sun, Q Pang, J Guo, T Zhou, H Cao Applied Catalysis A: General 466, 68-76, 2013 | 51 | 2013 |
Investigation of chloride-induced depassivation of iron in alkaline media by reactive force field molecular dynamics H DorMohammadi, Q Pang, P Murkute, L Árnadóttir, OB Isgor npj Materials Degradation 3 (1), 19, 2019 | 50 | 2019 |
Atomistic simulation of initial stages of iron corrosion in pure water using reactive molecular dynamics H DorMohammadi, Q Pang, L Árnadóttir, OB Isgor Computational Materials Science 145, 126-133, 2018 | 47 | 2018 |
Investigation of iron passivity in highly alkaline media using reactive-force field molecular dynamics H DorMohammadi, Q Pang, P Murkute, L Árnadóttir, OB Isgor Corrosion Science 157, 31-40, 2019 | 45 | 2019 |
The effect of surface vacancies on the interactions of Cl with a α-Fe2O3 (0001) surface and the role of Cl in depassivation Q Pang, H DorMohammadi, OB Isgor, L Árnadóttir Corrosion Science 154, 61-69, 2019 | 34 | 2019 |
Development of novel CaCO3/Fe2O3 nanorods for low temperature 1,2-dichlorobenzene oxidation X Ma, M Zhao, Q Pang, M Zheng, H Sun, J Crittenden, Y Zhu, Y Chen Applied Catalysis A: General 522, 70-79, 2016 | 27 | 2016 |
Density functional theory study on the effect of OH and Cl adsorption on the surface structure of α-Fe2O3 Q Pang, H DorMohammadi, OB Isgor, L Árnadóttir Computational and Theoretical Chemistry 1100, 91-101, 2017 | 25 | 2017 |
Dissociative adsorption of 2, 3, 7, 8-TCDD on the surfaces of typical metal oxides: a first-principles density functional theory study S Zhao, X Ma, Q Pang, H Sun, G Wang Physical Chemistry Chemical Physics 16 (12), 5553-5562, 2014 | 16 | 2014 |
The effect of surface defects on chloride-induced depassivation of iron - a density functional theory study Q Pang, H DorMohammadi, B Isgor, L Árnadóttir CORROSION, 2020 | 15 | 2020 |
Thermodynamic feasibility of the four-stage chloride-induced depassivation mechanism of iron Q Pang, H DorMohammadi, OB Isgor, L Árnadóttir npj Materials Degradation 4 (1), 1-5, 2020 | 11 | 2020 |
Mass transport in a highly immiscible alloy on extended shear deformation M Song, J Liu, X Ma, Q Pang, MJ Olszta, J Silverstein, MR Pallaka, ... Journal of Materials Science & Technology, 2022 | 4 | 2022 |
Extended Shear Deformation of the Immiscible Cu–Nb Alloy Resulting in Nanostructuring and Oxygen Ingress with Enhancement in Mechanical Properties B Gwalani, Q Pang, A Yu, W Fu, L Li, M Pole, C Roach, SN Mathaudhu, ... ACS Omega, 2022 | 3 | 2022 |
Metastable orientation relationships in thin film Cu-Cr bilayers TC Kaspar, Q Pang, PV Sushko, ME Bowden, J Tao, B Gwalani, M Olszta, ... Scripta Materialia 194, 113635, 2021 | 3 | 2021 |
Density Functional Theory Study of the Reaction Mechanism of Chloride-induced Depassivation of α-Fe2O3 Q Pang | 2 | 2019 |
Active Sampling for Neural Network Potentials: Accelerated Simulations of Shear-induced Deformation in Cu-Ni Multilayers H Sprueill, JA Bilbrey, Q Pang, P V. Sushko The Journal of Chemical Physics, 2023 | | 2023 |
Water Adsorption and Surface Atom Detachment on Zn, Al, Ce-Doped Mg Surfaces Q Pang, M Song, R Kalsar, VV Joshi, PV Sushko Magnesium Technology 2022, 291-292, 2022 | | 2022 |
Density Functional Theory Study of the Effect of Step Edges on α-Fe2O3 Surfaces on Cl-Surface Interactions and the Cl-Induced Depassivation Process Q Pang, H DorMohammadi, OB Isgor, L Arnadottir 2018 AIChE Annual Meeting, 2018 | | 2018 |
Reactive Molecular Dynamics Modeling of Chloride-Induced Depassivation of Iron Passive Film in Alkaline Media H DorMohammad, Q Pang, L Árnadóttir, OB Isgor Electrochemical Society Meeting Abstracts 233, 1099-1099, 2018 | | 2018 |
Density Functional Theory Study of the Interactions of Cl and α-Fe2O3 Surfaces: The Role of Cl in the Depassivation Process Q Pang, H DorMohammad, OB Isgor, L Árnadóttir Electrochemical Society Meeting Abstracts 233, 1100-1100, 2018 | | 2018 |
Density Functional Theory Study of the Interactions of OH and Cl with the Pristine and Defective Surfaces of α-Fe2O3 (0001) Q Pang, H DorMohammad, OB Isgor, L Árnadóttir Electrochemical Society Meeting Abstracts 232, 2031-2031, 2017 | | 2017 |